N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-3,4-bis(chloranyl)benzamide

Systemtic Name: N-[2-(azepan-1-yl)-2-thiophen-3-yl-ethyl]-3,4-bis(chloranyl)benzamide Openeye Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-3,4-dichloro-benzamide CAS Name: N-[2-(1-azepanyl)-2-(3-thiophenyl)ethyl]-3,4-dichlorobenzamide IUPAC Name: N-[2-(azepan-1-yl)-2-thiophen-3-ylethyl]-3,4-dichlorobenzamide Traditional Name: N-[2-(azepan-1-yl)-2-(3-thienyl)ethyl]-3,4-dichloro-benzamide Formula: C19H22Cl2N2OS MolecularWeight: 397.36178

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(CNC(=O)C2=CC(=C(C=C2)Cl)Cl)C3=CSC=C3

Isomeric SMILES

C1CCCN(CC1)C(CNC(=O)C2=CC(=C(C=C2)Cl)Cl)C3=CSC=C3

InChI

InChI=1S/C19H22Cl2N2OS/c20-16-6-5-14(11-17(16)21)19(24)22-12-18(15-7-10-25-13-15)23-8-3-1-2-4-9-23/h5-7,10-11,13,18H,1-4,8-9,12H2,(H,22,24)